3-[(2-ethoxyphenyl)-oxidanyl-methyl]-9-oxidanylidene-2,3-dihydro-1H-cyclopenta[b]chromene-7-carboxylic acid

Systemtic Name: 3-[(2-ethoxyphenyl)-oxidanyl-methyl]-9-oxidanylidene-2,3-dihydro-1H-cyclopenta[b]chromene-7-carboxylic acid Openeye Name: 3-[(2-ethoxyphenyl)-hydroxy-methyl]-9-oxo-2,3-dihydro-1H-cyclopenta[b]chromene-7-carboxylic acid CAS Name: 3-[(2-ethoxyphenyl)-hydroxymethyl]-9-oxo-2,3-dihydro-1H-cyclopenta[b][1]benzopyran-7-carboxylic acid IUPAC Name: 3-[(2-ethoxyphenyl)-hydroxymethyl]-9-oxo-2,3-dihydro-1H-cyclopenta[b]chromene-7-carboxylic acid Traditional Name: 3-[hydroxy(o-phenetyl)methyl]-9-keto-2,3-dihydro-1H-cyclopenta[b]chromene-7-carboxylic acid Formula: C22H20O6 MolecularWeight: 380.3906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(C2CCC3=C2OC4=C(C3=O)C=C(C=C4)C(=O)O)O

Isomeric SMILES

CCOC1=CC=CC=C1C(C2CCC3=C2OC4=C(C3=O)C=C(C=C4)C(=O)O)O

InChI

InChI=1S/C22H20O6/c1-2-27-17-6-4-3-5-13(17)19(23)14-8-9-15-20(24)16-11-12(22(25)26)7-10-18(16)28-21(14)15/h3-7,10-11,14,19,23H,2,8-9H2,1H3,(H,25,26)